(2S)-N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide

Systemtic Name: (2S)-N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Openeye Name: (2S)-N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-methyl-2-(2-thienylsulfonylamino)butanamide CAS Name: (2S)-N-[4-(4-acetamidophenyl)-2-thiazolyl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide IUPAC Name: (2S)-N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Traditional Name: (2S)-N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-methyl-2-(2-thienylsulfonylamino)butyramide Formula: C20H22N4O4S3 MolecularWeight: 478.60808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H22N4O4S3/c1-12(2)18(24-31(27,28)17-5-4-10-29-17)19(26)23-20-22-16(11-30-20)14-6-8-15(9-7-14)21-13(3)25/h4-12,18,24H,1-3H3,(H,21,25)(H,22,23,26)/t18-/m0/s1